3-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-(phenylcarbamoyl)propanamide

Systemtic Name: 3-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-(phenylcarbamoyl)propanamide Openeye Name: 3-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-(phenylcarbamoyl)propanamide CAS Name: N-[anilino(oxo)methyl]-3-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]propanamide IUPAC Name: 3-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-N-(phenylcarbamoyl)propanamide Traditional Name: 3-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]-N-(phenylcarbamoyl)propionamide Formula: C24H19FN4O2S MolecularWeight: 446.496663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC(=O)CCSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC(=O)CCSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H19FN4O2S/c25-17-12-10-16(11-13-17)22-19-8-4-5-9-20(19)23(29-28-22)32-15-14-21(30)27-24(31)26-18-6-2-1-3-7-18/h1-13H,14-15H2,(H2,26,27,30,31)